SCHEMBL7872398

SCHEMBL7872398

Cc1nc2cccc3n(CCCCNS(C)(=O)=O)c(=O)c1n23

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.42
TLR7 Q9NYK1 1/20 0.40
PLK1 P53350 2/20 0.35
HTT P42858 2/20 0.34
POLB P06746 1/20 0.34
ALDH1A1 P00352 1/20 0.33
IRAK1 P51617 2/20 0.32
NPY5R Q15761 3/20 0.32
NQO2 P16083 1/20 0.32
TRPV4 Q9HBA0 1/20 0.31
PRKCG P05129 1/20 0.31
PRKCB P05771 1/20 0.31
PRKCA P17252 1/20 0.31
GSK3B P49841 1/20 0.31
CNR2 P34972 1/20 0.30
PIK3CD O00329 1/20 0.30
PIK3R2 O00459 1/20 0.30
PIK3CG P48736 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL7871546 0.99 TDP1 (0.41) TDP1TLR7PLK1HTTPOLB
SCHEMBL7871625 0.97 TDP1 (0.38) TDP1TLR7PLK1HTTPOLB
Hydrochloric Acid SCHEMBL7870301 0.96 TDP1 (0.38) TDP1TLR7PLK1HTTPOLB
SCHEMBL7868943 0.91 MEN1 (0.38) TDP1TLR7HTTALDH1A1NPY5R
Hydrochloric Acid SCHEMBL7871692 0.90 MEN1 (0.37) TDP1TLR7HTTALDH1A1NPY5R
SCHEMBL7868566 0.88 KDM4E (0.33) TDP1TLR7HTTALDH1A1
Hydrochloric Acid SCHEMBL7870671 0.87 HRH1 (0.34) TDP1TLR7HTTALDH1A1
SCHEMBL7871755 0.87 EPHX1 (0.35) TDP1TLR7HTTPOLBALDH1A1
SCHEMBL7872436 0.87 ALDH1A1 (0.44) HTTALDH1A1
SCHEMBL7863469 0.86 EPHX1 (0.37) TDP1TLR7HTTPOLBALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010051631-A1 Tricyclic compounds, their production and use TAKATANI MUNEO (JP) 2001-12-13 US disclosed
US-6251905-B1 Tricyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-06-26 US disclosed
EP-0771319-A1 TRICYCLIC COMPOUNDS, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-05-07 EP disclosed
WO-1996002542-A1 TRICYCLIC COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-02-01 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010051631-A1 Tricyclic compounds, their production and use PDGFA, HGF, REN TDP1 2771/4885TLR7 3395/4885PLK1 2819/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.